Chemical Properties of Succinic acid, eicosyl 1-(pentafluorophenyl)ethyl ester

InChI

InChI=1S/C32H49F5O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-40-25(38)21-22-26(39)41-24(2)27-28(33)30(35)32(37)31(36)29(27)34/h24H,3-23H2,1-2H3

InChI Key

DYZRQOXOKXXGOL-UHFFFAOYSA-N

Formula

C32H49F5O4

SMILES

CCCCCCCCCCCCCCCCCCCCOC(=O)CCC(=O)OC(C)c1c(F)c(F)c(F)c(F)c1F

Molecular Weight¹

592.72

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-1161.51	kJ/mol	Joback Calculated Property
ΔfH°gas	-2000.06	kJ/mol	Joback Calculated Property
ΔfusH°	88.18	kJ/mol	Joback Calculated Property
ΔvapH°	106.25	kJ/mol	Joback Calculated Property
log10WS	-12.16		Crippen Calculated Property
logPoct/wat	10.351		Crippen Calculated Property
McVol	461.710	ml/mol	McGowan Calculated Property
Pc	578.13	kPa	Joback Calculated Property
Inp	[3319.00; 3319.00]
Inp	3319.00		NIST
Inp	3319.00		NIST
Tboil	1131.63	K	Joback Calculated Property
Tc	1464.42	K	Joback Calculated Property
Tfus	671.69	K	Joback Calculated Property
Vc	1.851	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1652.04; 1718.63]	J/mol×K	[1131.63; 1464.42]
Cp,gas	1652.04	J/mol×K	1131.63	Joback Calculated Property
Cp,gas	1672.28	J/mol×K	1187.10	Joback Calculated Property
Cp,gas	1688.63	J/mol×K	1242.56	Joback Calculated Property
Cp,gas	1701.26	J/mol×K	1298.03	Joback Calculated Property
Cp,gas	1710.36	J/mol×K	1353.49	Joback Calculated Property
Cp,gas	1716.09	J/mol×K	1408.96	Joback Calculated Property
Cp,gas	1718.63	J/mol×K	1464.42	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, eicosyl 1-(pentafluorophenyl)ethyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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